3-(6,6-dimethyl-4-oxidanylidene-5,7-dihydro-1H-indol-3-yl)propanoic acid

Systemtic Name: 3-(6,6-dimethyl-4-oxidanylidene-5,7-dihydro-1H-indol-3-yl)propanoic acid Openeye Name: 3-(6,6-dimethyl-4-oxo-5,7-dihydro-1H-indol-3-yl)propanoic acid CAS Name: 3-(6,6-dimethyl-4-oxo-5,7-dihydro-1H-indol-3-yl)propanoic acid IUPAC Name: 3-(6,6-dimethyl-4-oxo-5,7-dihydro-1H-indol-3-yl)propanoic acid Traditional Name: 3-(4-keto-6,6-dimethyl-5,7-dihydro-1H-indol-3-yl)propionic acid Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=O)C1)C(=CN2)CCC(=O)O)C

Isomeric SMILES

CC1(CC2=C(C(=O)C1)C(=CN2)CCC(=O)O)C

InChI

InChI=1S/C13H17NO3/c1-13(2)5-9-12(10(15)6-13)8(7-14-9)3-4-11(16)17/h7,14H,3-6H2,1-2H3,(H,16,17)